200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 139158-07-9
139158-07-9 | 2-Piperidinecarbonitrile, 2-[(3-methoxyphenyl)methyl]-1-methyl-
CAS No: 139158-07-9 Catalog No: AG001AFC MDL No:
Product Description
Catalog Number:
AG001AFC
Chemical Name:
2-Piperidinecarbonitrile, 2-[(3-methoxyphenyl)methyl]-1-methyl-
CAS Number:
139158-07-9
Molecular Formula:
C15H20N2O
Molecular Weight:
244.3321
IUPAC Name:
2-[(3-methoxyphenyl)methyl]-1-methylpiperidine-2-carbonitrile
InChI:
InChI=1S/C15H20N2O/c1-17-9-4-3-8-15(17,12-16)11-13-6-5-7-14(10-13)18-2/h5-7,10H,3-4,8-9,11H2,1-2H3
InChI Key:
HFBGTKSBNLORRZ-UHFFFAOYSA-N
SMILES:
N#CC1(CCCCN1C)Cc1cccc(c1)OC
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.158g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.338g/mol
Monoisotopic Mass:
244.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.